Product Name Sodium dichloroacetate
CAS2156-56-1
MFC2H3Cl2NaO2
MW152.93
InChIInChI=1S/C2H2Cl2O2.Na/c3-1(4)2(5)6;/h1H,(H,5,6);/q;+1/p-1
InChIKeyLUPNKHXLFSSUGS-UHFFFAOYSA-M
SmilesC([O-])(=O)C(Cl)Cl.[Na+]
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90 MHz in D2O
Assign. Shift(ppm) A 6.063
Hz ppm Int.
542.94 6.063 1000
in D2O
KBr disc
liquid film
nujol mull
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Sodium dichloroacetate(2156-56-1)IR1 Atlas of Related Products
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